3-amino-N-butan-2-yl-N-ethylpropanamide

C9H20N2O — CID 43274458

IUPAC3-amino-N-butan-2-yl-N-ethylpropanamide
SMILESCCC(C)N(CC)C(=O)CCN
InChIInChI=1S/C9H20N2O/c1-4-8(3)11(5-2)9(12)6-7-10/h8H,4-7,10H2,1-3H3
InChIKeyMYUUDSAWKGENCR-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.98
Rot. Bonds5

About 3-amino-N-butan-2-yl-N-ethylpropanamide

3-amino-N-butan-2-yl-N-ethylpropanamide (PubChem CID 43274458) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 3-amino-N-butan-2-yl-N-ethylpropanamide.

Molecular Properties

Compound Name3-amino-N-butan-2-yl-N-ethylpropanamide
PubChem CID43274458
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name3-amino-N-butan-2-yl-N-ethylpropanamide
SMILESCCC(C)N(CC)C(=O)CCN
InChIInChI=1S/C9H20N2O/c1-4-8(3)11(5-2)9(12)6-7-10/h8H,4-7,10H2,1-3H3
InChIKeyMYUUDSAWKGENCR-UHFFFAOYSA-N
XLogP0.98
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-amino-N-butan-2-yl-N-ethylbutanamide
CID 43274608
3-amino-N-ethyl-N-(1-ethylsulfonylpropan-2-yl)propanamide;hydrochloride
CID 119325085
N-butan-2-yl-5-chloro-N-ethylpentanamide
CID 43274439
3-amino-N-butan-2-yl-N-[(4-chlorophenyl)methyl]propanamide
CID 112501851
3-amino-N-propan-2-yl-N-propylpropanamide
CID 43269470
N-butan-2-yl-N-ethyl-3-oxobutanamide
CID 43274631
3-[4-aminobutanoyl(ethyl)amino]butanoic acid
CID 62826769
3-amino-N-butan-2-yl-N-(furan-2-ylmethyl)propanamide
CID 112501488
5-amino-N-butan-2-yl-N-ethyl-2-methylpentanamide
CID 104683623
N-butan-2-yl-N-ethylcarbamoyl bromide
CID 140982150
3-amino-N,N-bis(2-methylpropyl)propanamide;hydrochloride
CID 119261436
3-amino-N,N'-diethyl-N'-propan-2-ylpropanehydrazide
CID 87500992

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-butan-2-yl-N-ethylpropanamide?
The IUPAC name of 3-amino-N-butan-2-yl-N-ethylpropanamide (CID 43274458) is 3-amino-N-butan-2-yl-N-ethylpropanamide.
What is the SMILES notation for 3-amino-N-butan-2-yl-N-ethylpropanamide?
The canonical SMILES for 3-amino-N-butan-2-yl-N-ethylpropanamide is CCC(C)N(CC)C(=O)CCN.
What is the InChIKey of 3-amino-N-butan-2-yl-N-ethylpropanamide?
The InChIKey is MYUUDSAWKGENCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-4-8(3)11(5-2)9(12)6-7-10/h8H,4-7,10H2,1-3H3.
What are the key properties of 3-amino-N-butan-2-yl-N-ethylpropanamide?
3-amino-N-butan-2-yl-N-ethylpropanamide has a molecular weight of 172.27 g/mol, XLogP of 0.98, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-butan-2-yl-N-ethylpropanamide is sourced from PubChem (CID 43274458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).